CID 439574

(3r,4r)-oxolane-2,3,4-triol

Structural Information

Molecular Formula

C₄H₈O₄

SMILES

C1[C@H]([C@H](C(O1)O)O)O

InChI

InChI=1S/C4H8O4/c5-2-1-8-4(7)3(2)6/h2-7H,1H2/t2-,3-,4?/m1/s1

InChIKey

FMAORJIQYMIRHF-HERZVMAMSA-N

Compound name

(3R,4R)-oxolane-2,3,4-triol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 6965
References: 19934
Patents: 120.04226 Da
Monoisotopic Mass: -1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	121.04954	120.0
[M+Na]+	143.03148	128.6
[M+NH4]+	138.07608	127.1
[M+K]+	159.00542	128.2
[M-H]-	119.03498	120.0
[M+Na-2H]-	141.01693	121.7
[M]+	120.04171	120.8
[M]-	120.04281	120.8

Literature stripe

literature stripe

Patent stripe

patents stripe